![4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol structure](/static/products/3816/381698-72-2.webp)
4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol
TL;DR: 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol (CAS 381698-72-2) is a chemical compound with molecular formula C20H16N2O2S and molecular weight 348.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-(2-thiophen-2-yl-3H-1,5-benzodiazepin-4-yl)phenol
Also Known As: 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol, 4-methoxy-2-(4-(thiophen-2-yl)-3H-benzo[b][1,4]diazepin-2-yl)phenol, 4-methoxy-2-[4-(thiophen-2-yl)-3H-1,5-benzodiazepin-2-yl]phenol, (6E)-4-methoxy-6-(4-thiophen-2-yl-1,3-dihydro-1,5-benzodiazepin-2-ylidene)cyclohexa-2,4-dien-1-one, (6E)-4-methoxy-6-(4-thiophen-2-yl-1,3-dihydro-1,5-benzodiazepin-2-ylidene)-1-cyclohexa-2,4-dienone
| Molecular Formula | C20H16N2O2S |
|---|---|
| Molecular Weight | 348.09 g/mol |
| LogP | 5.1076 |
| Topological Polar Surface Area | 54.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.09326 |
| Heavy Atoms | 25 |
| Complexity | 975.12103 |
Chemical Identifiers
| CAS Number | 381698-72-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)O)C2=NC3=CC=CC=C3N=C(C2)C4=CC=CS4 |
Product Overview
4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol (CAS 381698-72-2), with molecular formula C20H16N2O2S and molecular weight 348.09 g/mol. IUPAC: 4-methoxy-2-(2-thiophen-2-yl-3H-1,5-benzodiazepin-4-yl)phenol.
Chemical Property Profile of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol
Property Insights of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol
The XLogP value of 5.1076 indicates that 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.18 Ų, 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol?
The CAS number of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol is 381698-72-2.
What is the molecular formula of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol?
The molecular formula of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol is C20H16N2O2S.
What is the molecular weight of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol?
The molecular weight of 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol is 348.09 g/mol.
Where can I buy 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol?
You can request a quote for 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-2-[4-(2-thienyl)-3H-1,5-benzodiazepin-2-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.